Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PGR | P06401 | 2/20 | 0.50 |
| ▸ | HRH4 | Q9H3N8 | 1/20 | 0.42 |
| ▸ | SLC22A12 | Q96S37 | 6/20 | 0.41 |
| ▸ | BACE2 | Q9Y5Z0 | 1/20 | 0.41 |
| ▸ | KIF11 | P52732 | 1/20 | 0.40 |
| ▸ | PARP14 | Q460N5 | 1/20 | 0.40 |
| ▸ | GCGR | P47871 | 1/20 | 0.38 |
| ▸ | TRPV4 | Q9HBA0 | 2/20 | 0.38 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.37 |
| ▸ | MEN1 | O00255 | 1/20 | 0.37 |
| ▸ | MLNR | O43193 | 1/20 | 0.37 |
| ▸ | LMNA | P02545 | 1/20 | 0.37 |
| ▸ | MMP1 | P03956 | 1/20 | 0.37 |
| ▸ | MPO | P05164 | 1/20 | 0.37 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.37 |
| ▸ | GLA | P06280 | 1/20 | 0.37 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.37 |
| ▸ | ADORA3 | P0DMS8 | 1/20 | 0.37 |
| ▸ | MAPT | P10636 | 1/20 | 0.37 |
| ▸ | CYP19A1 | P11511 | 1/20 | 0.37 |
Click a target to see other patent compounds predicted against it — the reverse direction, in place.
Similar compounds — the chemically nearest patent molecules
Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.
| Compound | similarity | top predicted | shared targets | |
|---|---|---|---|---|
| SCHEMBL22819242 | 0.81 | BACE2 (0.42) | PGRHRH4BACE2GCGRTRPV4 | |
| SCHEMBL4650319 | 0.80 | PSEN1 (0.46) | PGRSLC22A12CYP3A4MAPT | |
| SCHEMBL16887440 | 0.80 | MRGPRX1 (0.47) | PGRKIF11KDM4EMEN1MLNR | |
| SCHEMBL4612598 | 0.79 | PGR (0.81) | PGR | |
| SCHEMBL15220190 | 0.78 | IDH1 (0.47) | PGRHRH4SLC22A12KIF11CYP19A1 | |
| SCHEMBL4138666 | 0.78 | GCGR (0.39) | PGRHRH4SLC22A12BACE2GCGR | |
| SCHEMBL16150577 | 0.78 | BACE2 (0.42) | PGRHRH4SLC22A12BACE2KIF11 | |
| SCHEMBL4398648 | 0.78 | PDK1 (0.45) | PGRHRH4BACE2GCGRCYP1A2 | |
| SCHEMBL10337745 | 0.78 | PTGS1 (0.61) | PGRSLC22A12PARP14KDM4EMEN1 | |
| SCHEMBL4650448 | 0.77 | SLC22A12 (0.51) | PGRSLC22A12TRPV4CYP3A4HPGD |
Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.
Patent provenance — the patents this molecule appears in, and who filed them
Claimed or disclosed in 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| WO-2006098554-A1 | NOVEL COMPOUNDS, ISOMER THEREOF OR PHARMACEUTICALLY ACCEPTABLE SALTS THEREOF AS VANILLOID RECEPTOR ANTAGONIST; AND A PHARMACEUTICAL COMPOSITION CONTAINING THE SAME | AMOREPACIFIC CORPORATION (KR) | 2006-09-21 | — | — | WO | disclosed |